(2-chloro-6-fluorophenyl)methyl 5-amino-2-phenyl-2H-1,2,3-triazole-4-carboxylate
Chemical Structure Depiction of
(2-chloro-6-fluorophenyl)methyl 5-amino-2-phenyl-2H-1,2,3-triazole-4-carboxylate
(2-chloro-6-fluorophenyl)methyl 5-amino-2-phenyl-2H-1,2,3-triazole-4-carboxylate
Compound characteristics
| Compound ID: | 8016-7015 |
| Compound Name: | (2-chloro-6-fluorophenyl)methyl 5-amino-2-phenyl-2H-1,2,3-triazole-4-carboxylate |
| Molecular Weight: | 346.75 |
| Molecular Formula: | C16 H12 Cl F N4 O2 |
| Smiles: | C(c1c(cccc1[Cl])F)OC(c1c(N)nn(c2ccccc2)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7498 |
| logD: | 2.7498 |
| logSw: | -3.2214 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.896 |
| InChI Key: | AFIWFRFPKFERHE-UHFFFAOYSA-N |